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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H32O3
Molecular Weight 308.4563
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ANDROSTANE-3,7,17-TRIOL, (3BETA,5ALPHA,7ALPHA,17BETA)-

SMILES

C[C@@]12CC[C@@]([H])(C[C@]2([H])C[C@]([H])([C@@]3([H])[C@]4([H])CC[C@@]([H])([C@@]4(C)CC[C@@]31[H])O)O)O

InChI

InChIKey=UFGLFVVFQFFPSV-LKBCLYITSA-N
InChI=1S/C19H32O3/c1-18-7-5-12(20)9-11(18)10-15(21)17-13-3-4-16(22)19(13,2)8-6-14(17)18/h11-17,20-22H,3-10H2,1-2H3/t11-,12+,13+,14+,15-,16+,17+,18+,19+/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H32O3
Molecular Weight 308.4563
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 02:33:18 UTC 2021
Edited
by admin
on Sat Jun 26 02:33:18 UTC 2021
Record UNII
7269TBU72V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ANDROSTANE-3,7,17-TRIOL, (3BETA,5ALPHA,7ALPHA,17BETA)-
Common Name English
5.ALPHA.-ANDROSTANE-3.BETA.,7.ALPHA.,17.BETA.-TRIOL
Systematic Name English
ANDROSTANE-3,7,17-TRIOL, (3.BETA.,5.ALPHA.,7.ALPHA.,17.BETA.)-
Systematic Name English
5.ALPHA.-ANDROSTAN-3.BETA.,7.ALPHA.,17.BETA.-TRIOL
Systematic Name English
Code System Code Type Description
FDA UNII
7269TBU72V
Created by admin on Sat Jun 26 02:33:18 UTC 2021 , Edited by admin on Sat Jun 26 02:33:18 UTC 2021
PRIMARY
PUBCHEM
161274
Created by admin on Sat Jun 26 02:33:18 UTC 2021 , Edited by admin on Sat Jun 26 02:33:18 UTC 2021
PRIMARY
CAS
19316-62-2
Created by admin on Sat Jun 26 02:33:18 UTC 2021 , Edited by admin on Sat Jun 26 02:33:18 UTC 2021
PRIMARY
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